1H-Indene, 2-propyl- supplier

Name
2-PROPYL-1 H-INDENE
EINECS
CAS No. 92013-11-1
Article Data2
CAS DataBase
Density 0.965 g/cm³
Solubility
Melting Point 71.5°C (estimate)
Formula C₁₂H₁₄
Boiling Point 243.9 °C at 760 mmHg
Molecular Weight 158.24
Flash Point 96 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-propyl-1H-indene;
PSA 0.00000
LogP 3.42620

1H-Indene, 2-propyl- Specification

The 1H-Indene, 2-propyl-, with the CAS registry number 92013-11-1, has the systematic name of 2-propyl-1H-indene. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₁₂H₁₄.

The characteristics of 1H-Indene, 2-propyl- are as followings: (1)ACD/LogP: 4.56; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.56; (4)ACD/LogD (pH 7.4): 4.56; (5)ACD/BCF (pH 5.5): 1719.84; (6)ACD/BCF (pH 7.4): 1719.84; (7)ACD/KOC (pH 5.5): 7203.78; (8)ACD/KOC (pH 7.4): 7203.78; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.547; (14)Molar Refractivity: 51.98 cm³; (15)Molar Volume: 163.8 cm³; (16)Polarizability: 20.6×10^-24cm³; (17)Surface Tension: 34.2 dyne/cm; (18)Density: 0.965 g/cm³; (19)Flash Point: 96 °C; (20)Enthalpy of Vaporization: 46.15 kJ/mol; (21)Boiling Point: 243.9 °C at 760 mmHg; (22)Vapour Pressure: 0.0487 mmHg at 25°C.

Uses of 1H-Indene, 2-propyl-: It can be used to produce 2-n-propylindan. This reaction will need reagent tetra-n-butylammonium H₂, catalyst PtO₂, and the menstruum tetrahydrofuran. The reaction pressure is 1034.3 - 1551.4Pa, and the yield is about 97%.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: c1cccc\2c1C/C(=C/2)CCC
(2)InChI: InChI=1/C12H14/c1-2-5-10-8-11-6-3-4-7-12(11)9-10/h3-4,6-8H,2,5,9H2,1H3
(3)InChIKey: DOUIKRLGKLTCJI-UHFFFAOYAL

Product Name

2-PROPYL-1 H-INDENE

1H-Indene, 2-propyl- Specification

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